Known targets — ChEMBL curated mechanism
ABCC9ABL1ACEACHEACVR1ADORA1ADORA2AADORA2BADORA3ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALOX5ATP4AATP4BBCRBTKCACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGCRBNCUL4ACXCR1CXCR2DDB1DDCDHFRDPP4DRD2DRD3DRD4EGFRERBB2ERBB4ESR1ESR2FDPSFKBP1AFLT1FLT3FLT4GARTGHSRGRIA1GRIA2GRIA3GRIA4GRIK1GRIK2GRIK3GRIK4GRIK5GRIN2AGSK3AGSK3BHDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IDH1IDH2IMPA1ITGA2BITGB3JAK1JAK2JAK3KCNJ11KCNK3KCNK9KDRKITMEN1METMMP1MMP13MMP7MMP8NANOD2NS5bODC1OPG057OPRD1OPRK1OPRM1PPARP1PARP2PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PKLRPPARDPPATPTGS1PTGS2RBX1ROCK1ROCK2RRM1RRM2RRM2BSCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC10A2SLC5A2SLC6A2SLC6A3SLC6A4SLC9A3SYKTACR1THRATHRBTOP1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYK2TYMSVDRampCblablaT-3blaT-4blaT-5blaT-6blaUOE-1dacAdacBdacCfolAfolPftsIgyrAgyrBileSmecAmrcAmrcBmrdAparCparEpbp2pbp4pbpApbpFrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUthyAykgMykgO
The experimentally established mechanism targets of Water. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 known ✓ | O00255 | 1/20 | 0.64 |
| ▸ | COMT | P21964 | 6/20 | 0.97 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.73 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.65 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.65 |
| ▸ | NSD2 | O96028 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | IDE | P14735 | 1/20 | 0.64 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.64 |
| ▸ | CCR6 | P51684 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.61 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.53 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Water SCHEMBL10628327 | 1.00 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| Ammonia Solution, Strong SCHEMBL28735696 | 0.98 | COMT (0.94) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL114961 | 0.98 | COMT (1.00) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL29456746 | 0.98 | COMT (1.00) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL7156190 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL1873349 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL11317138 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL9407080 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL9511337 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 | |
| SCHEMBL8847297 | 0.97 | COMT (0.97) | COMTFTOALDH1A1CYP1A2ALOX15 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 364 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3824059-B1 | CLEANING COMPOSITION WITH CORROSION INHIBITOR | ENTEGRIS INC (US) | 2025-09-17 | — | — | EP | claimed |
| EP-3880688-B1 | OLIGOSACCHARIDE PREPARATIONS AND COMPOSITIONS | DSM IP ASSETS BV (NL) | 2025-09-17 | — | — | EP | claimed |
| US-11655267-B2 | Oligosaccharide preparations and compositions | DSM IP ASSETS B.V. (NL) | 2023-05-23 | — | — | US | claimed |
| US-20220275420-A1 | ENZYMATIC BIOCATHODE, METHOD FOR PRODUCING IT AND FUEL BIOCELL AND BIOSENSOR COMPRISING THIS ENZYMATIC BIOCATHODE | UNIVERSITÉ GRENOBLE ALPES (FR) | 2022-09-01 | — | — | US | claimed |
| US-20210395284-A1 | OLIGOSACCHARIDE PREPARATIONS AND COMPOSITIONS | DSM IP ASSETS B.V. (NL) | 2021-12-23 | — | — | US | claimed |
| CN-113557239-A | Oligosaccharide formulations and compositions | 米德瑞美国有限公司 | 2021-10-26 | — | — | CN | claimed |
| US-11149235-B2 | Cleaning composition with corrosion inhibitor | ENTEGRIS, INC. (US) | 2021-10-19 | — | — | US | claimed |
| EP-3880688-A1 | OLIGOSACCHARIDE PREPARATIONS AND COMPOSITIONS | Midori USA, Inc. (US) | 2021-09-22 | — | — | EP | claimed |
| CN-110357068-B | Synthetic method of hierarchical porous carbon nano material | 中国科学技术大学 | 2021-08-13 | — | — | CN | claimed |
| EP-3824059-A1 | CLEANING COMPOSITION WITH CORROSION INHIBITOR | Entegris, Inc. (US) | 2021-05-26 | — | — | EP | claimed |
| WO-2002094945-A1 | METHOD FOR THE PRODUCTION OF PLANE-PARALLEL PLATELETS BY USING ORGANIC SEPARATING AGENTS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2002-11-28 | — | — | WO | claimed |
| EP-0743574-B1 | Migration imaging members | XEROX CORP (US) | 2000-12-27 | — | — | EP | claimed |
| EP-0743573-B1 | Method for obtaining image contrast migration imaging members | XEROX CORP (US) | 2000-09-06 | — | — | EP | claimed |
| US-5597702-A | ENZYME INHIBITOR | ABBOTT LABORATORIES (US) | 1997-01-28 | — | — | US | claimed |
| EP-0743573-A2 | Method for obtaining image contrast migration imaging members | XEROX CORPORATION (US) | 1996-11-20 | — | — | EP | claimed |
| EP-0743574-A2 | Migration imaging members | XEROX CORPORATION (US) | 1996-11-20 | — | — | EP | claimed |
| EP-0736181-A1 | AUTOMATED LEAD ASSAY | Abbott Laboratories (US) | 1996-10-09 | — | — | EP | claimed |
| US-5563014-A | SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT | XEROX CORPORATION (US) | 1996-10-08 | — | — | US | claimed |
| US-5514505-A | SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE | XEROX CORPORATION (US) | 1996-05-07 | — | — | US | claimed |
| WO-1995017679-A1 | AUTOMATED LEAD ASSAY | ABBOTT LABORATORIES (US) | 1995-06-29 | — | — | WO | claimed |